N-[4-(2-cyclohexylethyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]-1,3-benzothiazol-6-amine

Systemtic Name: N-[4-(2-cyclohexylethyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]-1,3-benzothiazol-6-amine Openeye Name: N-[4-(2-cyclohexylethyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]-1,3-benzothiazol-6-amine CAS Name: N-[4-(2-cyclohexylethyl)-6-(1-piperazinyl)-1,3,5-triazin-2-yl]-1,3-benzothiazol-6-amine IUPAC Name: N-[4-(2-cyclohexylethyl)-6-piperazin-1-yl-1,3,5-triazin-2-yl]-1,3-benzothiazol-6-amine Traditional Name: 1,3-benzothiazol-6-yl-[4-(2-cyclohexylethyl)-6-piperazino-s-triazin-2-yl]amine Formula: C22H29N7S MolecularWeight: 423.57756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=CS4)N5CCNCC5

Isomeric SMILES

C1CCC(CC1)CCC2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=CS4)N5CCNCC5

InChI

InChI=1S/C22H29N7S/c1-2-4-16(5-3-1)6-9-20-26-21(28-22(27-20)29-12-10-23-11-13-29)25-17-7-8-18-19(14-17)30-15-24-18/h7-8,14-16,23H,1-6,9-13H2,(H,25,26,27,28)